4-[2-[4-[(4-cyanophenyl)-phenyl-methyl]-2-propan-2-yl-piperazin-1-yl]-2-oxidanylidene-ethyl]piperidine-1-carboxamide

Systemtic Name: 4-[2-[4-[(4-cyanophenyl)-phenyl-methyl]-2-propan-2-yl-piperazin-1-yl]-2-oxidanylidene-ethyl]piperidine-1-carboxamide Openeye Name: 4-[2-[4-[(4-cyanophenyl)-phenyl-methyl]-2-isopropyl-piperazin-1-yl]-2-oxo-ethyl]piperidine-1-carboxamide CAS Name: 4-[2-[4-[(4-cyanophenyl)-phenylmethyl]-2-propan-2-yl-1-piperazinyl]-2-oxoethyl]-1-piperidinecarboxamide IUPAC Name: 4-[2-[4-[(4-cyanophenyl)-phenylmethyl]-2-propan-2-ylpiperazin-1-yl]-2-oxoethyl]piperidine-1-carboxamide Traditional Name: 4-[2-[4-[(4-cyanophenyl)-phenyl-methyl]-2-isopropyl-piperazino]-2-keto-ethyl]piperidine-1-carboxamide Formula: C29H37N5O2 MolecularWeight: 487.63638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1C(=O)CC2CCN(CC2)C(=O)N)C(C3=CC=CC=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)C1CN(CCN1C(=O)CC2CCN(CC2)C(=O)N)C(C3=CC=CC=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C29H37N5O2/c1-21(2)26-20-33(16-17-34(26)27(35)18-22-12-14-32(15-13-22)29(31)36)28(24-6-4-3-5-7-24)25-10-8-23(19-30)9-11-25/h3-11,21-22,26,28H,12-18,20H2,1-2H3,(H2,31,36)